1-[1-azanyl-5-[2,3-bis(oxidanyl)propylamino]-4-methyl-2-oxidanylidene-pentyl]-4,5-dihydro-3H-1-benzazepin-2-one

Systemtic Name: 1-[1-azanyl-5-[2,3-bis(oxidanyl)propylamino]-4-methyl-2-oxidanylidene-pentyl]-4,5-dihydro-3H-1-benzazepin-2-one Openeye Name: 1-[1-amino-5-(2,3-dihydroxypropylamino)-4-methyl-2-oxo-pentyl]-4,5-dihydro-3H-1-benzazepin-2-one CAS Name: 1-[1-amino-5-(2,3-dihydroxypropylamino)-4-methyl-2-oxopentyl]-4,5-dihydro-3H-1-benzazepin-2-one IUPAC Name: 1-[1-amino-5-(2,3-dihydroxypropylamino)-4-methyl-2-oxopentyl]-4,5-dihydro-3H-1-benzazepin-2-one Traditional Name: 1-[1-amino-5-(glycerylamino)-2-keto-4-methyl-pentyl]-4,5-dihydro-3H-1-benzazepin-2-one Formula: C19H29N3O4 MolecularWeight: 363.45126

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C(N)N1C(=O)CCCC2=CC=CC=C21)CNCC(CO)O

Isomeric SMILES

CC(CC(=O)C(N)N1C(=O)CCCC2=CC=CC=C21)CNCC(CO)O

InChI

InChI=1S/C19H29N3O4/c1-13(10-21-11-15(24)12-23)9-17(25)19(20)22-16-7-3-2-5-14(16)6-4-8-18(22)26/h2-3,5,7,13,15,19,21,23-24H,4,6,8-12,20H2,1H3