ethyl 2-[2-oxidanylidene-3-[[(3S)-2-oxidanylideneazepan-3-yl]amino]-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoate

Systemtic Name: ethyl 2-[2-oxidanylidene-3-[[(3S)-2-oxidanylideneazepan-3-yl]amino]-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoate Openeye Name: ethyl 2-[2-oxo-3-[[(3S)-2-oxoazepan-3-yl]amino]-4,5-dihydro-3H-1-benzazepin-1-yl]acetate CAS Name: 2-[2-oxo-3-[[(3S)-2-oxo-3-azepanyl]amino]-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-oxo-3-[[(3S)-2-oxoazepan-3-yl]amino]-4,5-dihydro-3H-1-benzazepin-1-yl]acetate Traditional Name: 2-[2-keto-3-[[(3S)-2-ketoazepan-3-yl]amino]-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid ethyl ester Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2CCC(C1=O)NC3CCCCNC3=O

Isomeric SMILES

CCOC(=O)CN1C2=CC=CC=C2CCC(C1=O)N[C@H]3CCCCNC3=O

InChI

InChI=1S/C20H27N3O4/c1-2-27-18(24)13-23-17-9-4-3-7-14(17)10-11-16(20(23)26)22-15-8-5-6-12-21-19(15)25/h3-4,7,9,15-16,22H,2,5-6,8,10-13H2,1H3,(H,21,25)/t15-,16?/m0/s1