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

Systemtic Name: 3-azanyl-1-[4-methyl-5-(3-oxidanylbutylamino)-2-oxidanylidene-pentyl]-4,5-dihydro-3H-1-benzazepin-2-one Openeye Name: 3-amino-1-[5-(3-hydroxybutylamino)-4-methyl-2-oxo-pentyl]-4,5-dihydro-3H-1-benzazepin-2-one CAS Name: 3-amino-1-[5-(3-hydroxybutylamino)-4-methyl-2-oxopentyl]-4,5-dihydro-3H-1-benzazepin-2-one IUPAC Name: 3-amino-1-[5-(3-hydroxybutylamino)-4-methyl-2-oxopentyl]-4,5-dihydro-3H-1-benzazepin-2-one Traditional Name: 3-amino-1-[5-(3-hydroxybutylamino)-2-keto-4-methyl-pentyl]-4,5-dihydro-3H-1-benzazepin-2-one Formula: C20H31N3O3 MolecularWeight: 361.47844

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNCC(C)CC(=O)CN1C2=CC=CC=C2CCC(C1=O)N)O

Isomeric SMILES

CC(CCNCC(C)CC(=O)CN1C2=CC=CC=C2CCC(C1=O)N)O

InChI

InChI=1S/C20H31N3O3/c1-14(12-22-10-9-15(2)24)11-17(25)13-23-19-6-4-3-5-16(19)7-8-18(21)20(23)26/h3-6,14-15,18,22,24H,7-13,21H2,1-2H3