(6-carbamimidoylnaphthalen-2-yl) (E)-3-[4-[bis(azanyl)methylideneamino]phenyl]prop-2-enoate

Systemtic Name: (6-carbamimidoylnaphthalen-2-yl) (E)-3-[4-[bis(azanyl)methylideneamino]phenyl]prop-2-enoate Openeye Name: (6-carbamimidoyl-2-naphthyl) (E)-3-(4-guanidinophenyl)prop-2-enoate CAS Name: (E)-3-[4-(diaminomethylideneamino)phenyl]-2-propenoic acid (6-carbamimidoyl-2-naphthalenyl) ester IUPAC Name: (6-carbamimidoylnaphthalen-2-yl) (E)-3-[4-(diaminomethylideneamino)phenyl]prop-2-enoate Traditional Name: (E)-3-(4-guanidinophenyl)acrylic acid (6-amidino-2-naphthyl) ester Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)OC2=CC3=C(C=C2)C=C(C=C3)C(=N)N)N=C(N)N

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)OC2=CC3=C(C=C2)C=C(C=C3)C(=N)N)N=C(N)N

InChI

InChI=1S/C21H19N5O2/c22-20(23)16-5-4-15-12-18(9-6-14(15)11-16)28-19(27)10-3-13-1-7-17(8-2-13)26-21(24)25/h1-12H,(H3,22,23)(H4,24,25,26)/b10-3+