2-[5-[2-[4-(dibutylamino)butylamino]-2-oxidanylidene-ethyl]-6-oxidanylidene-11H-benzo[c][1]benzazepin-11-yl]ethanoic acid

Systemtic Name: 2-[5-[2-[4-(dibutylamino)butylamino]-2-oxidanylidene-ethyl]-6-oxidanylidene-11H-benzo[c][1]benzazepin-11-yl]ethanoic acid Openeye Name: 2-[5-[2-[4-(dibutylamino)butylamino]-2-oxo-ethyl]-6-oxo-11H-benzo[c][1]benzazepin-11-yl]acetic acid CAS Name: 2-[5-[2-[4-(dibutylamino)butylamino]-2-oxoethyl]-6-oxo-11H-benzo[c][1]benzazepin-11-yl]acetic acid IUPAC Name: 2-[5-[2-[4-(dibutylamino)butylamino]-2-oxoethyl]-6-oxo-11H-benzo[c][1]benzazepin-11-yl]acetic acid Traditional Name: 2-[5-[2-[4-(dibutylamino)butylamino]-2-keto-ethyl]-6-keto-11H-benzo[c][1]benzazepin-11-yl]acetic acid Formula: C30H41N3O4 MolecularWeight: 507.66424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCCNC(=O)CN1C2=CC=CC=C2C(C3=CC=CC=C3C1=O)CC(=O)O

Isomeric SMILES

CCCCN(CCCC)CCCCNC(=O)CN1C2=CC=CC=C2C(C3=CC=CC=C3C1=O)CC(=O)O

InChI

InChI=1S/C30H41N3O4/c1-3-5-18-32(19-6-4-2)20-12-11-17-31-28(34)22-33-27-16-10-9-14-24(27)26(21-29(35)36)23-13-7-8-15-25(23)30(33)37/h7-10,13-16,26H,3-6,11-12,17-22H2,1-2H3,(H,31,34)(H,35,36)