N-[(E)-(10-chloranylanthracen-9-yl)methylideneamino]-3-(4-phenylpiperazin-1-yl)propanamide

Systemtic Name: N-[(E)-(10-chloranylanthracen-9-yl)methylideneamino]-3-(4-phenylpiperazin-1-yl)propanamide Openeye Name: N-[(E)-(10-chloro-9-anthryl)methyleneamino]-3-(4-phenylpiperazin-1-yl)propanamide CAS Name: N-[(E)-(10-chloro-9-anthracenyl)methylideneamino]-3-(4-phenyl-1-piperazinyl)propanamide IUPAC Name: N-[(E)-(10-chloroanthracen-9-yl)methylideneamino]-3-(4-phenylpiperazin-1-yl)propanamide Traditional Name: N-[(E)-(10-chloro-9-anthryl)methyleneamino]-3-(4-phenylpiperazino)propionamide Formula: C28H27ClN4O MolecularWeight: 470.99318

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NN=CC2=C3C=CC=CC3=C(C4=CC=CC=C42)Cl)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCC(=O)N/N=C/C2=C3C=CC=CC3=C(C4=CC=CC=C42)Cl)C5=CC=CC=C5

InChI

InChI=1S/C28H27ClN4O/c29-28-24-12-6-4-10-22(24)26(23-11-5-7-13-25(23)28)20-30-31-27(34)14-15-32-16-18-33(19-17-32)21-8-2-1-3-9-21/h1-13,20H,14-19H2,(H,31,34)/b30-20+