2-[5-[2-[4-[3-(dipropylamino)propyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-6-oxidanylidene-11H-benzo[c][1]benzazepin-11-yl]ethanoic acid

Systemtic Name: 2-[5-[2-[4-[3-(dipropylamino)propyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-6-oxidanylidene-11H-benzo[c][1]benzazepin-11-yl]ethanoic acid Openeye Name: 2-[5-[2-[4-[3-(dipropylamino)propyl]piperazin-1-yl]-2-oxo-ethyl]-6-oxo-11H-benzo[c][1]benzazepin-11-yl]acetic acid CAS Name: 2-[5-[2-[4-[3-(dipropylamino)propyl]-1-piperazinyl]-2-oxoethyl]-6-oxo-11H-benzo[c][1]benzazepin-11-yl]acetic acid IUPAC Name: 2-[5-[2-[4-[3-(dipropylamino)propyl]piperazin-1-yl]-2-oxoethyl]-6-oxo-11H-benzo[c][1]benzazepin-11-yl]acetic acid Traditional Name: 2-[5-[2-[4-[3-(dipropylamino)propyl]piperazino]-2-keto-ethyl]-6-keto-11H-benzo[c][1]benzazepin-11-yl]acetic acid Formula: C31H42N4O4 MolecularWeight: 534.68958

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCCN1CCN(CC1)C(=O)CN2C3=CC=CC=C3C(C4=CC=CC=C4C2=O)CC(=O)O

Isomeric SMILES

CCCN(CCC)CCCN1CCN(CC1)C(=O)CN2C3=CC=CC=C3C(C4=CC=CC=C4C2=O)CC(=O)O

InChI

InChI=1S/C31H42N4O4/c1-3-14-32(15-4-2)16-9-17-33-18-20-34(21-19-33)29(36)23-35-28-13-8-7-11-25(28)27(22-30(37)38)24-10-5-6-12-26(24)31(35)39/h5-8,10-13,27H,3-4,9,14-23H2,1-2H3,(H,37,38)