2-azanyl-4,6-dimethyl-3-oxidanylidene-N1,N9-bis[2-(4-phenylpiperazin-1-yl)ethyl]phenoxazine-1,9-dicarboxamide

Systemtic Name: 2-azanyl-4,6-dimethyl-3-oxidanylidene-N1,N9-bis[2-(4-phenylpiperazin-1-yl)ethyl]phenoxazine-1,9-dicarboxamide Openeye Name: 2-amino-4,6-dimethyl-3-oxo-N1,N9-bis[2-(4-phenylpiperazin-1-yl)ethyl]phenoxazine-1,9-dicarboxamide CAS Name: 2-amino-4,6-dimethyl-3-oxo-N1,N9-bis[2-(4-phenyl-1-piperazinyl)ethyl]phenoxazine-1,9-dicarboxamide IUPAC Name: 2-amino-4,6-dimethyl-3-oxo-1-N,9-N-bis[2-(4-phenylpiperazin-1-yl)ethyl]phenoxazine-1,9-dicarboxamide Traditional Name: 2-amino-3-keto-4,6-dimethyl-N,N'-bis[2-(4-phenylpiperazino)ethyl]phenoxazine-1,9-dicarboxamide Formula: C40H46N8O4 MolecularWeight: 702.84444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4)N=C5C(=C(C(=O)C(=C5O2)C)N)C(=O)NCCN6CCN(CC6)C7=CC=CC=C7

Isomeric SMILES

CC1=C2C(=C(C=C1)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4)N=C5C(=C(C(=O)C(=C5O2)C)N)C(=O)NCCN6CCN(CC6)C7=CC=CC=C7

InChI

InChI=1S/C40H46N8O4/c1-27-13-14-31(39(50)42-15-17-45-19-23-47(24-20-45)29-9-5-3-6-10-29)34-37(27)52-38-28(2)36(49)33(41)32(35(38)44-34)40(51)43-16-18-46-21-25-48(26-22-46)30-11-7-4-8-12-30/h3-14H,15-26,41H2,1-2H3,(H,42,50)(H,43,51)