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

Systemtic Name: N-[4-methyl-1-oxidanylidene-1-[[3-oxidanylidene-1-(phenylmethyl)azepan-4-yl]amino]pentan-2-yl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide Openeye Name: N-[1-[(1-benzyl-3-oxo-azepan-4-yl)carbamoyl]-3-methyl-butyl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide CAS Name: N-[4-methyl-1-oxo-1-[[3-oxo-1-(phenylmethyl)-4-azepanyl]amino]pentan-2-yl]-2,3-dihydro-1,4-benzodioxin-5-carboxamide IUPAC Name: N-[1-[(1-benzyl-3-oxoazepan-4-yl)amino]-4-methyl-1-oxopentan-2-yl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide Traditional Name: N-[1-[(1-benzyl-3-keto-azepan-4-yl)carbamoyl]-3-methyl-butyl]-2,3-dihydro-1,4-benzodioxin-5-carboxamide Formula: C28H35N3O5 MolecularWeight: 493.5946

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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=C4C(=CC=C3)OCCO4

Isomeric SMILES

CC(C)CC(C(=O)NC1CCCN(CC1=O)CC2=CC=CC=C2)NC(=O)C3=C4C(=CC=C3)OCCO4

InChI

InChI=1S/C28H35N3O5/c1-19(2)16-23(30-27(33)21-10-6-12-25-26(21)36-15-14-35-25)28(34)29-22-11-7-13-31(18-24(22)32)17-20-8-4-3-5-9-20/h3-6,8-10,12,19,22-23H,7,11,13-18H2,1-2H3,(H,29,34)(H,30,33)