N-[4-methyl-1-oxidanylidene-1-[[3-oxidanylidene-1-(phenylmethyl)azepan-4-yl]amino]pentan-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-methyl-1-oxidanylidene-1-[[3-oxidanylidene-1-(phenylmethyl)azepan-4-yl]amino]pentan-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[1-[(1-benzyl-3-oxo-azepan-4-yl)carbamoyl]-3-methyl-butyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-methyl-1-oxo-1-[[3-oxo-1-(phenylmethyl)-4-azepanyl]amino]pentan-2-yl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[1-[(1-benzyl-3-oxoazepan-4-yl)amino]-4-methyl-1-oxopentan-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[1-[(1-benzyl-3-keto-azepan-4-yl)carbamoyl]-3-methyl-butyl]-piperonylamide Formula: C27H33N3O5 MolecularWeight: 479.56802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1CCCN(CC1=O)CC2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)CC(C(=O)NC1CCCN(CC1=O)CC2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C27H33N3O5/c1-18(2)13-22(29-26(32)20-10-11-24-25(14-20)35-17-34-24)27(33)28-21-9-6-12-30(16-23(21)31)15-19-7-4-3-5-8-19/h3-5,7-8,10-11,14,18,21-22H,6,9,12-13,15-17H2,1-2H3,(H,28,33)(H,29,32)