tert-butyl N-[3-[1-butyl-3-[(6,7-dimethoxynaphthalen-2-yl)sulfonylamino]-2-oxidanylidene-azepan-3-yl]propyl]carbamate

Systemtic Name: tert-butyl N-[3-[1-butyl-3-[(6,7-dimethoxynaphthalen-2-yl)sulfonylamino]-2-oxidanylidene-azepan-3-yl]propyl]carbamate Openeye Name: tert-butyl N-[3-[1-butyl-3-[(6,7-dimethoxy-2-naphthyl)sulfonylamino]-2-oxo-azepan-3-yl]propyl]carbamate CAS Name: N-[3-[1-butyl-3-[(6,7-dimethoxy-2-naphthalenyl)sulfonylamino]-2-oxo-3-azepanyl]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[1-butyl-3-[(6,7-dimethoxynaphthalen-2-yl)sulfonylamino]-2-oxoazepan-3-yl]propyl]carbamate Traditional Name: N-[3-[1-butyl-3-[(6,7-dimethoxy-2-naphthyl)sulfonylamino]-2-keto-azepan-3-yl]propyl]carbamic acid tert-butyl ester Formula: C30H45N3O7S MolecularWeight: 591.7592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCCC(C1=O)(CCCNC(=O)OC(C)(C)C)NS(=O)(=O)C2=CC3=CC(=C(C=C3C=C2)OC)OC

Isomeric SMILES

CCCCN1CCCCC(C1=O)(CCCNC(=O)OC(C)(C)C)NS(=O)(=O)C2=CC3=CC(=C(C=C3C=C2)OC)OC

InChI

InChI=1S/C30H45N3O7S/c1-7-8-17-33-18-10-9-14-30(27(33)34,15-11-16-31-28(35)40-29(2,3)4)32-41(36,37)24-13-12-22-20-25(38-5)26(39-6)21-23(22)19-24/h12-13,19-21,32H,7-11,14-18H2,1-6H3,(H,31,35)