N-butyl-6-methyl-4-[[3-methyl-2-(2-naphthalen-2-ylethanoylamino)pentanoyl]amino]-3-oxidanyl-heptanamide

Systemtic Name: N-butyl-6-methyl-4-[[3-methyl-2-(2-naphthalen-2-ylethanoylamino)pentanoyl]amino]-3-oxidanyl-heptanamide Openeye Name: N-butyl-3-hydroxy-6-methyl-4-[[3-methyl-2-[[2-(2-naphthyl)acetyl]amino]pentanoyl]amino]heptanamide CAS Name: N-butyl-3-hydroxy-6-methyl-4-[[3-methyl-2-[[2-(2-naphthalenyl)-1-oxoethyl]amino]-1-oxopentyl]amino]heptanamide IUPAC Name: N-butyl-3-hydroxy-6-methyl-4-[[3-methyl-2-[(2-naphthalen-2-ylacetyl)amino]pentanoyl]amino]heptanamide Traditional Name: N-butyl-3-hydroxy-6-methyl-4-[[3-methyl-2-[[2-(2-naphthyl)acetyl]amino]pentanoyl]amino]enanthamide Formula: C30H45N3O4 MolecularWeight: 511.696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CC(C(CC(C)C)NC(=O)C(C(C)CC)NC(=O)CC1=CC2=CC=CC=C2C=C1)O

Isomeric SMILES

CCCCNC(=O)CC(C(CC(C)C)NC(=O)C(C(C)CC)NC(=O)CC1=CC2=CC=CC=C2C=C1)O

InChI

InChI=1S/C30H45N3O4/c1-6-8-15-31-27(35)19-26(34)25(16-20(3)4)32-30(37)29(21(5)7-2)33-28(36)18-22-13-14-23-11-9-10-12-24(23)17-22/h9-14,17,20-21,25-26,29,34H,6-8,15-16,18-19H2,1-5H3,(H,31,35)(H,32,37)(H,33,36)