N-[3-[[1-[(3-azanyl-2-oxidanyl-propyl)amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]amino]-3-oxidanylidene-propyl]-N-cycloheptyl-benzamide

Systemtic Name: N-[3-[[1-[(3-azanyl-2-oxidanyl-propyl)amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]amino]-3-oxidanylidene-propyl]-N-cycloheptyl-benzamide Openeye Name: N-[3-[[2-[(3-amino-2-hydroxy-propyl)amino]-1-(2-naphthylmethyl)-2-oxo-ethyl]amino]-3-oxo-propyl]-N-cycloheptyl-benzamide CAS Name: N-[3-[[1-[(3-amino-2-hydroxypropyl)amino]-3-(2-naphthalenyl)-1-oxopropan-2-yl]amino]-3-oxopropyl]-N-cycloheptylbenzamide IUPAC Name: N-[3-[[1-[(3-amino-2-hydroxypropyl)amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]amino]-3-oxopropyl]-N-cycloheptylbenzamide Traditional Name: N-[3-[[2-[(3-amino-2-hydroxy-propyl)amino]-2-keto-1-(2-naphthylmethyl)ethyl]amino]-3-keto-propyl]-N-cycloheptyl-benzamide Formula: C33H42N4O4 MolecularWeight: 558.71098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N(CCC(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCC(CN)O)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCC(CC1)N(CCC(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCC(CN)O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C33H42N4O4/c34-22-29(38)23-35-32(40)30(21-24-16-17-25-10-8-9-13-27(25)20-24)36-31(39)18-19-37(28-14-6-1-2-7-15-28)33(41)26-11-4-3-5-12-26/h3-5,8-13,16-17,20,28-30,38H,1-2,6-7,14-15,18-19,21-23,34H2,(H,35,40)(H,36,39)