N-[1-[[1-(diethylamino)-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]azepane-1-carboxamide

Systemtic Name: N-[1-[[1-(diethylamino)-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]azepane-1-carboxamide Openeye Name: N-[1-[[1-[(4-benzyloxyphenyl)methyl]-2-(diethylamino)ethyl]carbamoyl]-3-methyl-butyl]azepane-1-carboxamide CAS Name: N-[1-[[1-(diethylamino)-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]-1-azepanecarboxamide IUPAC Name: N-[1-[[1-(diethylamino)-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]azepane-1-carboxamide Traditional Name: N-[1-[[1-(4-benzoxybenzyl)-2-(diethylamino)ethyl]carbamoyl]-3-methyl-butyl]azepane-1-carboxamide Formula: C33H50N4O3 MolecularWeight: 550.7751

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C(CC(C)C)NC(=O)N3CCCCCC3

Isomeric SMILES

CCN(CC)CC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C(CC(C)C)NC(=O)N3CCCCCC3

InChI

InChI=1S/C33H50N4O3/c1-5-36(6-2)24-29(23-27-16-18-30(19-17-27)40-25-28-14-10-9-11-15-28)34-32(38)31(22-26(3)4)35-33(39)37-20-12-7-8-13-21-37/h9-11,14-19,26,29,31H,5-8,12-13,20-25H2,1-4H3,(H,34,38)(H,35,39)