3-azanyl-N-[(2S)-1-[[1-(dimethylamino)cyclopentyl]methylamino]-1-oxidanylidene-pentan-2-yl]-4-hexoxy-benzamide

Systemtic Name: 3-azanyl-N-[(2S)-1-[[1-(dimethylamino)cyclopentyl]methylamino]-1-oxidanylidene-pentan-2-yl]-4-hexoxy-benzamide Openeye Name: 3-amino-N-[(1S)-1-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]butyl]-4-hexoxy-benzamide CAS Name: 3-amino-N-[(2S)-1-[[1-(dimethylamino)cyclopentyl]methylamino]-1-oxopentan-2-yl]-4-hexoxybenzamide IUPAC Name: 3-amino-N-[(2S)-1-[[1-(dimethylamino)cyclopentyl]methylamino]-1-oxopentan-2-yl]-4-hexoxybenzamide Traditional Name: 3-amino-N-[(1S)-1-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]butyl]-4-hexoxy-benzamide Formula: C26H44N4O3 MolecularWeight: 460.65256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(CCC)C(=O)NCC2(CCCC2)N(C)C)N

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)N[C@@H](CCC)C(=O)NCC2(CCCC2)N(C)C)N

InChI

InChI=1S/C26H44N4O3/c1-5-7-8-11-17-33-23-14-13-20(18-21(23)27)24(31)29-22(12-6-2)25(32)28-19-26(30(3)4)15-9-10-16-26/h13-14,18,22H,5-12,15-17,19,27H2,1-4H3,(H,28,32)(H,29,31)/t22-/m0/s1