2-ethyl-5-[3-[4-(4-hydroxyphenyl)piperazin-1-yl]propyl]-6H-pyrrolo[3,4-c]azepin-4-one

Systemtic Name: 2-ethyl-5-[3-[4-(4-hydroxyphenyl)piperazin-1-yl]propyl]-6H-pyrrolo[3,4-c]azepin-4-one Openeye Name: 2-ethyl-5-[3-[4-(4-hydroxyphenyl)piperazin-1-yl]propyl]-6H-pyrrolo[3,4-c]azepin-4-one CAS Name: 2-ethyl-5-[3-[4-(4-hydroxyphenyl)-1-piperazinyl]propyl]-6H-pyrrolo[3,4-c]azepin-4-one IUPAC Name: 2-ethyl-5-[3-[4-(4-hydroxyphenyl)piperazin-1-yl]propyl]-6H-pyrrolo[3,4-c]azepin-4-one Traditional Name: 2-ethyl-5-[3-[4-(4-hydroxyphenyl)piperazino]propyl]-6H-pyrrol[3,4-c]azepin-4-one Formula: C23H30N4O2 MolecularWeight: 394.5099

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C2C=CCN(C(=O)C2=C1)CCCN3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

CCN1C=C2C=CCN(C(=O)C2=C1)CCCN3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C23H30N4O2/c1-2-24-17-19-5-3-11-27(23(29)22(19)18-24)12-4-10-25-13-15-26(16-14-25)20-6-8-21(28)9-7-20/h3,5-9,17-18,28H,2,4,10-16H2,1H3