ethyl 4-[3-[3-(phenothiazin-10-ylmethyl)phenyl]carbonylindol-1-yl]butanoate

Systemtic Name: ethyl 4-[3-[3-(phenothiazin-10-ylmethyl)phenyl]carbonylindol-1-yl]butanoate Openeye Name: ethyl 4-[3-[3-(phenothiazin-10-ylmethyl)benzoyl]indol-1-yl]butanoate CAS Name: 4-[3-[oxo-[3-(10-phenothiazinylmethyl)phenyl]methyl]-1-indolyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[3-[3-(phenothiazin-10-ylmethyl)benzoyl]indol-1-yl]butanoate Traditional Name: 4-[3-[3-(phenothiazin-10-ylmethyl)benzoyl]indol-1-yl]butyric acid ethyl ester Formula: C34H30N2O3S MolecularWeight: 546.6786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC(=CC=C3)CN4C5=CC=CC=C5SC6=CC=CC=C64

Isomeric SMILES

CCOC(=O)CCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC(=CC=C3)CN4C5=CC=CC=C5SC6=CC=CC=C64

InChI

InChI=1S/C34H30N2O3S/c1-2-39-33(37)19-10-20-35-23-27(26-13-3-4-14-28(26)35)34(38)25-12-9-11-24(21-25)22-36-29-15-5-7-17-31(29)40-32-18-8-6-16-30(32)36/h3-9,11-18,21,23H,2,10,19-20,22H2,1H3