1-[4-[(E)-3-(4-ethyl-3-nitro-phenyl)prop-2-enoyl]phenyl]-3-propan-2-yl-urea

Systemtic Name: 1-[4-[(E)-3-(4-ethyl-3-nitro-phenyl)prop-2-enoyl]phenyl]-3-propan-2-yl-urea Openeye Name: 1-[4-[(E)-3-(4-ethyl-3-nitro-phenyl)prop-2-enoyl]phenyl]-3-isopropyl-urea CAS Name: 1-[4-[(E)-3-(4-ethyl-3-nitrophenyl)-1-oxoprop-2-enyl]phenyl]-3-propan-2-ylurea IUPAC Name: 1-[4-[(E)-3-(4-ethyl-3-nitrophenyl)prop-2-enoyl]phenyl]-3-propan-2-ylurea Traditional Name: 1-[4-[(E)-3-(4-ethyl-3-nitro-phenyl)acryloyl]phenyl]-3-isopropyl-urea Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)NC(=O)NC(C)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)NC(=O)NC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O4/c1-4-16-7-5-15(13-19(16)24(27)28)6-12-20(25)17-8-10-18(11-9-17)23-21(26)22-14(2)3/h5-14H,4H2,1-3H3,(H2,22,23,26)/b12-6+